(E)-4-[(4-azanyl-3-bromanyl-phenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(4-azanyl-3-bromanyl-phenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(4-amino-3-bromo-anilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(4-amino-3-bromoanilino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(4-amino-3-bromoanilino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(4-amino-3-bromo-anilino)-4-keto-but-2-enoic acid Formula: C10H9BrN2O3 MolecularWeight: 285.09406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C=CC(=O)O)Br)N

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)/C=C/C(=O)O)Br)N

InChI

InChI=1S/C10H9BrN2O3/c11-7-5-6(1-2-8(7)12)13-9(14)3-4-10(15)16/h1-5H,12H2,(H,13,14)(H,15,16)/b4-3+